USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0425 (180deg=-0.734) USER MOD Single : A 1 MET N :NH3+ -168:sc= 2.31 (180deg=2.26) USER MOD Single : A 2 GLN : amide:sc= 0.728 K(o=0.73,f=-1.4) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0657 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 170:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0315 USER MOD Single : A 22 THR OG1 : rot 135:sc= 0.154 USER MOD Single : A 25 ASN : amide:sc= 0.279 K(o=0.28,f=-0.95) USER MOD Single : A 27 LYS NZ :NH3+ 170:sc= 1.96 (180deg=1.75) USER MOD Single : A 29 LYS NZ :NH3+ -153:sc= 1.03 (180deg=0.706) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 33 LYS NZ :NH3+ 133:sc= 1.19 (180deg=1.05) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 41 GLN : amide:sc= 1.36 K(o=1.4,f=-2.4!) USER MOD Single : A 48 LYS NZ :NH3+ -155:sc= -0.0581 (180deg=-0.644) USER MOD Single : A 49 GLN : amide:sc= 0.349 X(o=0.35,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc=-0.00585 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 150:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.0186 K(o=-0.019,f=-2) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -96:sc= 1.1 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.332 X(o=-0.33,f=-0.00069) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.503 30.919 15.805 1.00 0.00 N ATOM 2 CA MET A 1 14.345 30.935 17.272 1.00 0.00 C ATOM 3 C MET A 1 15.585 31.327 18.082 1.00 0.00 C ATOM 4 O MET A 1 16.680 30.886 17.714 1.00 0.00 O ATOM 5 CB MET A 1 13.722 29.677 17.876 1.00 0.00 C ATOM 6 CG MET A 1 14.584 28.419 17.977 1.00 0.00 C ATOM 7 SD MET A 1 13.918 27.295 19.241 1.00 0.00 S ATOM 8 CE MET A 1 15.457 26.658 19.964 1.00 0.00 C ATOM 0 H1 MET A 1 13.568 30.843 15.356 1.00 0.00 H new ATOM 0 H2 MET A 1 14.965 31.798 15.496 1.00 0.00 H new ATOM 0 H3 MET A 1 15.088 30.105 15.528 1.00 0.00 H new ATOM 0 HA MET A 1 13.628 31.750 17.371 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.378 29.926 18.880 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.838 29.428 17.288 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.616 27.913 17.012 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.609 28.692 18.228 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.242 25.762 20.546 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.159 26.413 19.167 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.895 27.416 20.613 1.00 0.00 H new ATOM 20 N GLN A 2 15.468 32.048 19.197 1.00 0.00 N ATOM 21 CA GLN A 2 16.603 32.491 19.988 1.00 0.00 C ATOM 22 C GLN A 2 17.120 31.395 20.931 1.00 0.00 C ATOM 23 O GLN A 2 16.385 30.594 21.504 1.00 0.00 O ATOM 24 CB GLN A 2 16.213 33.599 20.970 1.00 0.00 C ATOM 25 CG GLN A 2 15.771 34.875 20.252 1.00 0.00 C ATOM 26 CD GLN A 2 14.331 34.870 19.758 1.00 0.00 C ATOM 27 OE1 GLN A 2 13.450 34.900 20.612 1.00 0.00 O ATOM 28 NE2 GLN A 2 14.005 34.820 18.474 1.00 0.00 N ATOM 0 H GLN A 2 14.568 32.342 19.576 1.00 0.00 H new ATOM 0 HA GLN A 2 17.336 32.800 19.243 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.405 33.246 21.612 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.060 33.823 21.618 1.00 0.00 H new ATOM 0 HG2 GLN A 2 15.904 35.719 20.929 1.00 0.00 H new ATOM 0 HG3 GLN A 2 16.431 35.042 19.400 1.00 0.00 H new ATOM 0 HE21 GLN A 2 14.736 34.795 17.763 1.00 0.00 H new ATOM 0 HE22 GLN A 2 13.023 34.807 18.197 1.00 0.00 H new ATOM 37 N ILE A 3 18.435 31.404 21.081 1.00 0.00 N ATOM 38 CA ILE A 3 19.212 30.695 22.081 1.00 0.00 C ATOM 39 C ILE A 3 20.205 31.695 22.677 1.00 0.00 C ATOM 40 O ILE A 3 20.396 32.698 22.004 1.00 0.00 O ATOM 41 CB ILE A 3 19.738 29.364 21.565 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.749 29.541 20.425 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.630 28.452 21.021 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.760 28.408 20.218 1.00 0.00 C ATOM 0 H ILE A 3 19.031 31.949 20.458 1.00 0.00 H new ATOM 0 HA ILE A 3 18.609 30.344 22.919 1.00 0.00 H new ATOM 0 HB ILE A 3 20.208 28.909 22.437 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.194 29.676 19.496 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.303 30.463 20.602 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.068 27.518 20.668 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.912 28.239 21.813 1.00 0.00 H new ATOM 0 HG23 ILE A 3 18.122 28.950 20.195 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.417 28.654 19.384 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.355 28.281 21.123 1.00 0.00 H new ATOM 0 HD13 ILE A 3 21.229 27.482 20.000 1.00 0.00 H new ATOM 56 N PHE A 4 20.739 31.507 23.881 1.00 0.00 N ATOM 57 CA PHE A 4 21.899 32.272 24.296 1.00 0.00 C ATOM 58 C PHE A 4 23.118 31.377 24.067 1.00 0.00 C ATOM 59 O PHE A 4 23.005 30.229 24.491 1.00 0.00 O ATOM 60 CB PHE A 4 21.760 32.759 25.742 1.00 0.00 C ATOM 61 CG PHE A 4 20.656 33.772 25.938 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.914 35.137 25.785 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.499 33.290 26.550 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.959 36.087 26.192 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.537 34.252 26.897 1.00 0.00 C ATOM 66 CZ PHE A 4 18.799 35.626 26.824 1.00 0.00 C ATOM 0 H PHE A 4 20.391 30.842 24.572 1.00 0.00 H new ATOM 0 HA PHE A 4 22.007 33.186 23.712 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.573 31.902 26.389 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.705 33.199 26.061 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.849 35.464 25.353 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.352 32.238 26.746 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.117 37.142 26.021 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.564 33.922 27.231 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.104 36.331 27.256 1.00 0.00 H new ATOM 76 N VAL A 5 24.259 31.930 23.659 1.00 0.00 N ATOM 77 CA VAL A 5 25.495 31.206 23.479 1.00 0.00 C ATOM 78 C VAL A 5 26.347 31.829 24.594 1.00 0.00 C ATOM 79 O VAL A 5 26.538 33.038 24.623 1.00 0.00 O ATOM 80 CB VAL A 5 26.101 31.224 22.082 1.00 0.00 C ATOM 81 CG1 VAL A 5 25.251 30.201 21.324 1.00 0.00 C ATOM 82 CG2 VAL A 5 26.194 32.610 21.431 1.00 0.00 C ATOM 0 H VAL A 5 24.341 32.923 23.441 1.00 0.00 H new ATOM 0 HA VAL A 5 25.381 30.125 23.557 1.00 0.00 H new ATOM 0 HB VAL A 5 27.158 30.959 22.085 1.00 0.00 H new ATOM 0 HG11 VAL A 5 25.601 30.129 20.294 1.00 0.00 H new ATOM 0 HG12 VAL A 5 25.338 29.227 21.806 1.00 0.00 H new ATOM 0 HG13 VAL A 5 24.208 30.517 21.332 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.638 32.517 20.440 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.196 33.038 21.342 1.00 0.00 H new ATOM 0 HG23 VAL A 5 26.814 33.261 22.047 1.00 0.00 H new ATOM 92 N LYS A 6 26.845 30.969 25.490 1.00 0.00 N ATOM 93 CA LYS A 6 27.476 31.539 26.661 1.00 0.00 C ATOM 94 C LYS A 6 28.881 30.945 26.654 1.00 0.00 C ATOM 95 O LYS A 6 29.115 29.752 26.862 1.00 0.00 O ATOM 96 CB LYS A 6 26.643 31.200 27.905 1.00 0.00 C ATOM 97 CG LYS A 6 27.345 31.671 29.182 1.00 0.00 C ATOM 98 CD LYS A 6 26.287 31.585 30.284 1.00 0.00 C ATOM 99 CE LYS A 6 26.884 32.063 31.609 1.00 0.00 C ATOM 100 NZ LYS A 6 25.747 32.239 32.521 1.00 0.00 N ATOM 0 H LYS A 6 26.824 29.951 25.430 1.00 0.00 H new ATOM 0 HA LYS A 6 27.538 32.627 26.665 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.663 31.671 27.830 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.477 30.124 27.953 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.204 31.041 29.413 1.00 0.00 H new ATOM 0 HG3 LYS A 6 27.716 32.690 29.073 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.424 32.196 30.021 1.00 0.00 H new ATOM 0 HD3 LYS A 6 25.933 30.559 30.383 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.593 31.335 32.004 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.428 32.998 31.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 26.092 32.566 33.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.092 32.944 32.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.251 31.332 32.637 1.00 0.00 H new ATOM 114 N THR A 7 29.902 31.782 26.539 1.00 0.00 N ATOM 115 CA THR A 7 31.297 31.398 26.411 1.00 0.00 C ATOM 116 C THR A 7 31.786 31.082 27.830 1.00 0.00 C ATOM 117 O THR A 7 31.272 31.674 28.770 1.00 0.00 O ATOM 118 CB THR A 7 32.119 32.616 25.975 1.00 0.00 C ATOM 119 OG1 THR A 7 31.469 33.321 24.927 1.00 0.00 O ATOM 120 CG2 THR A 7 33.495 32.274 25.411 1.00 0.00 C ATOM 0 H THR A 7 29.772 32.794 26.532 1.00 0.00 H new ATOM 0 HA THR A 7 31.399 30.573 25.706 1.00 0.00 H new ATOM 0 HB THR A 7 32.222 33.198 26.891 1.00 0.00 H new ATOM 0 HG1 THR A 7 32.012 34.095 24.667 1.00 0.00 H new ATOM 0 HG21 THR A 7 34.010 33.192 25.127 1.00 0.00 H new ATOM 0 HG22 THR A 7 34.078 31.750 26.168 1.00 0.00 H new ATOM 0 HG23 THR A 7 33.381 31.636 24.535 1.00 0.00 H new ATOM 128 N LEU A 8 32.674 30.099 27.984 1.00 0.00 N ATOM 129 CA LEU A 8 33.347 29.765 29.227 1.00 0.00 C ATOM 130 C LEU A 8 33.844 30.914 30.107 1.00 0.00 C ATOM 131 O LEU A 8 33.858 30.770 31.327 1.00 0.00 O ATOM 132 CB LEU A 8 34.475 28.741 29.077 1.00 0.00 C ATOM 133 CG LEU A 8 35.667 29.249 28.270 1.00 0.00 C ATOM 134 CD1 LEU A 8 37.012 28.897 28.912 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.512 28.655 26.868 1.00 0.00 C ATOM 0 H LEU A 8 32.951 29.493 27.212 1.00 0.00 H new ATOM 0 HA LEU A 8 32.504 29.326 29.761 1.00 0.00 H new ATOM 0 HB2 LEU A 8 34.819 28.446 30.068 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.079 27.846 28.597 1.00 0.00 H new ATOM 0 HG LEU A 8 35.671 30.338 28.233 1.00 0.00 H new ATOM 0 HD11 LEU A 8 37.822 29.284 28.294 1.00 0.00 H new ATOM 0 HD12 LEU A 8 37.069 29.342 29.905 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.104 27.814 28.994 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.340 28.984 26.240 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.515 27.567 26.932 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.571 28.990 26.433 1.00 0.00 H new ATOM 147 N THR A 9 34.307 32.053 29.603 1.00 0.00 N ATOM 148 CA THR A 9 34.524 33.316 30.284 1.00 0.00 C ATOM 149 C THR A 9 33.355 33.865 31.117 1.00 0.00 C ATOM 150 O THR A 9 33.577 34.426 32.194 1.00 0.00 O ATOM 151 CB THR A 9 35.115 34.279 29.265 1.00 0.00 C ATOM 152 OG1 THR A 9 34.320 34.162 28.103 1.00 0.00 O ATOM 153 CG2 THR A 9 36.608 34.161 28.980 1.00 0.00 C ATOM 0 H THR A 9 34.562 32.117 28.617 1.00 0.00 H new ATOM 0 HA THR A 9 35.233 33.153 31.095 1.00 0.00 H new ATOM 0 HB THR A 9 35.079 35.280 29.694 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.660 34.768 27.412 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.896 34.905 28.237 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.168 34.330 29.899 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.828 33.164 28.599 1.00 0.00 H new ATOM 161 N GLY A 10 32.123 33.704 30.642 1.00 0.00 N ATOM 162 CA GLY A 10 30.882 34.078 31.285 1.00 0.00 C ATOM 163 C GLY A 10 30.135 35.090 30.407 1.00 0.00 C ATOM 164 O GLY A 10 29.136 35.638 30.855 1.00 0.00 O ATOM 0 H GLY A 10 31.962 33.277 29.730 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.264 33.195 31.447 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.084 34.510 32.265 1.00 0.00 H new ATOM 168 N LYS A 11 30.574 35.321 29.178 1.00 0.00 N ATOM 169 CA LYS A 11 30.141 36.353 28.257 1.00 0.00 C ATOM 170 C LYS A 11 28.903 35.770 27.574 1.00 0.00 C ATOM 171 O LYS A 11 29.093 34.850 26.768 1.00 0.00 O ATOM 172 CB LYS A 11 31.214 36.674 27.224 1.00 0.00 C ATOM 173 CG LYS A 11 30.850 37.804 26.257 1.00 0.00 C ATOM 174 CD LYS A 11 31.903 37.920 25.152 1.00 0.00 C ATOM 175 CE LYS A 11 31.484 38.761 23.948 1.00 0.00 C ATOM 176 NZ LYS A 11 32.121 38.439 22.663 1.00 0.00 N ATOM 0 H LYS A 11 31.305 34.739 28.768 1.00 0.00 H new ATOM 0 HA LYS A 11 29.936 37.289 28.776 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.133 36.942 27.745 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.425 35.774 26.647 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.871 37.614 25.817 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.778 38.747 26.800 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.810 38.349 25.578 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.157 36.918 24.806 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.405 38.666 23.826 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.688 39.807 24.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.756 39.075 21.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.151 38.559 22.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 31.907 37.454 22.407 1.00 0.00 H new ATOM 190 N THR A 12 27.702 36.195 27.956 1.00 0.00 N ATOM 191 CA THR A 12 26.430 35.737 27.444 1.00 0.00 C ATOM 192 C THR A 12 25.874 36.637 26.350 1.00 0.00 C ATOM 193 O THR A 12 25.568 37.811 26.566 1.00 0.00 O ATOM 194 CB THR A 12 25.355 35.666 28.527 1.00 0.00 C ATOM 195 OG1 THR A 12 25.877 34.855 29.557 1.00 0.00 O ATOM 196 CG2 THR A 12 23.923 35.221 28.214 1.00 0.00 C ATOM 0 H THR A 12 27.593 36.911 28.674 1.00 0.00 H new ATOM 0 HA THR A 12 26.648 34.745 27.048 1.00 0.00 H new ATOM 0 HB THR A 12 25.177 36.715 28.762 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.220 34.781 30.280 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.327 35.244 29.126 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.485 35.895 27.478 1.00 0.00 H new ATOM 0 HG23 THR A 12 23.936 34.207 27.815 1.00 0.00 H new ATOM 204 N ILE A 13 25.719 35.969 25.208 1.00 0.00 N ATOM 205 CA ILE A 13 25.421 36.544 23.904 1.00 0.00 C ATOM 206 C ILE A 13 24.258 35.795 23.262 1.00 0.00 C ATOM 207 O ILE A 13 24.019 34.637 23.600 1.00 0.00 O ATOM 208 CB ILE A 13 26.630 36.686 22.977 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.814 37.397 23.619 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.306 37.173 21.560 1.00 0.00 C ATOM 211 CD1 ILE A 13 27.650 38.907 23.788 1.00 0.00 C ATOM 0 H ILE A 13 25.804 34.953 25.170 1.00 0.00 H new ATOM 0 HA ILE A 13 25.119 37.577 24.075 1.00 0.00 H new ATOM 0 HB ILE A 13 26.963 35.659 22.824 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.995 36.955 24.599 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.702 37.209 23.015 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.226 37.242 20.980 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.626 36.469 21.080 1.00 0.00 H new ATOM 0 HG23 ILE A 13 25.835 38.155 21.611 1.00 0.00 H new ATOM 0 HD11 ILE A 13 28.545 39.320 24.253 1.00 0.00 H new ATOM 0 HD12 ILE A 13 27.503 39.369 22.812 1.00 0.00 H new ATOM 0 HD13 ILE A 13 26.785 39.111 24.420 1.00 0.00 H new ATOM 223 N THR A 14 23.336 36.349 22.483 1.00 0.00 N ATOM 224 CA THR A 14 22.292 35.670 21.731 1.00 0.00 C ATOM 225 C THR A 14 22.738 35.086 20.399 1.00 0.00 C ATOM 226 O THR A 14 23.769 35.404 19.794 1.00 0.00 O ATOM 227 CB THR A 14 21.190 36.710 21.502 1.00 0.00 C ATOM 228 OG1 THR A 14 21.484 37.902 20.811 1.00 0.00 O ATOM 229 CG2 THR A 14 20.505 37.197 22.783 1.00 0.00 C ATOM 0 H THR A 14 23.298 37.360 22.352 1.00 0.00 H new ATOM 0 HA THR A 14 21.961 34.806 22.307 1.00 0.00 H new ATOM 0 HB THR A 14 20.569 36.083 20.862 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.651 38.377 20.609 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.739 37.930 22.530 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.043 36.351 23.293 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.244 37.656 23.439 1.00 0.00 H new ATOM 237 N LEU A 15 21.909 34.219 19.827 1.00 0.00 N ATOM 238 CA LEU A 15 21.977 33.621 18.505 1.00 0.00 C ATOM 239 C LEU A 15 20.569 33.266 18.035 1.00 0.00 C ATOM 240 O LEU A 15 19.745 32.808 18.815 1.00 0.00 O ATOM 241 CB LEU A 15 23.010 32.516 18.331 1.00 0.00 C ATOM 242 CG LEU A 15 23.609 32.289 16.945 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.838 33.092 16.544 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.025 30.820 16.847 1.00 0.00 C ATOM 0 H LEU A 15 21.089 33.886 20.334 1.00 0.00 H new ATOM 0 HA LEU A 15 22.379 34.377 17.830 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.832 32.720 19.018 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.551 31.580 18.651 1.00 0.00 H new ATOM 0 HG LEU A 15 22.815 32.617 16.274 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.140 32.815 15.534 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.603 34.156 16.574 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.653 32.881 17.237 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.457 30.629 15.865 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.763 30.599 17.618 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.151 30.184 16.989 1.00 0.00 H new ATOM 256 N GLU A 16 20.245 33.421 16.747 1.00 0.00 N ATOM 257 CA GLU A 16 19.081 32.910 16.044 1.00 0.00 C ATOM 258 C GLU A 16 19.435 31.593 15.362 1.00 0.00 C ATOM 259 O GLU A 16 20.351 31.491 14.539 1.00 0.00 O ATOM 260 CB GLU A 16 18.608 33.934 15.024 1.00 0.00 C ATOM 261 CG GLU A 16 17.480 34.833 15.524 1.00 0.00 C ATOM 262 CD GLU A 16 16.044 34.321 15.636 1.00 0.00 C ATOM 263 OE1 GLU A 16 15.836 33.098 15.509 1.00 0.00 O ATOM 264 OE2 GLU A 16 15.161 35.065 16.106 1.00 0.00 O ATOM 0 H GLU A 16 20.849 33.955 16.122 1.00 0.00 H new ATOM 0 HA GLU A 16 18.273 32.730 16.753 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.453 34.557 14.731 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.272 33.411 14.128 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.770 35.185 16.514 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.456 35.705 14.871 1.00 0.00 H new ATOM 271 N VAL A 17 18.765 30.520 15.772 1.00 0.00 N ATOM 272 CA VAL A 17 18.896 29.164 15.280 1.00 0.00 C ATOM 273 C VAL A 17 17.539 28.699 14.737 1.00 0.00 C ATOM 274 O VAL A 17 16.496 29.054 15.267 1.00 0.00 O ATOM 275 CB VAL A 17 19.592 28.159 16.211 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.970 28.632 16.687 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.679 27.965 17.412 1.00 0.00 C ATOM 0 H VAL A 17 18.066 30.587 16.512 1.00 0.00 H new ATOM 0 HA VAL A 17 19.617 29.193 14.463 1.00 0.00 H new ATOM 0 HB VAL A 17 19.763 27.233 15.663 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.408 27.878 17.341 1.00 0.00 H new ATOM 0 HG12 VAL A 17 21.619 28.787 15.825 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.864 29.569 17.234 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.134 27.256 18.104 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.532 28.920 17.916 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.716 27.579 17.078 1.00 0.00 H new ATOM 287 N GLU A 18 17.569 27.831 13.725 1.00 0.00 N ATOM 288 CA GLU A 18 16.310 27.351 13.176 1.00 0.00 C ATOM 289 C GLU A 18 16.047 26.087 13.996 1.00 0.00 C ATOM 290 O GLU A 18 16.983 25.291 14.104 1.00 0.00 O ATOM 291 CB GLU A 18 16.389 27.104 11.674 1.00 0.00 C ATOM 292 CG GLU A 18 15.131 26.607 10.968 1.00 0.00 C ATOM 293 CD GLU A 18 15.020 26.755 9.463 1.00 0.00 C ATOM 294 OE1 GLU A 18 15.990 26.370 8.773 1.00 0.00 O ATOM 295 OE2 GLU A 18 13.943 27.169 8.966 1.00 0.00 O ATOM 0 H GLU A 18 18.413 27.462 13.288 1.00 0.00 H new ATOM 0 HA GLU A 18 15.495 28.071 13.255 1.00 0.00 H new ATOM 0 HB2 GLU A 18 16.695 28.035 11.197 1.00 0.00 H new ATOM 0 HB3 GLU A 18 17.182 26.378 11.495 1.00 0.00 H new ATOM 0 HG2 GLU A 18 15.020 25.548 11.203 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.280 27.123 11.412 1.00 0.00 H new ATOM 302 N PRO A 19 14.826 25.863 14.459 1.00 0.00 N ATOM 303 CA PRO A 19 14.430 24.575 14.988 1.00 0.00 C ATOM 304 C PRO A 19 14.821 23.230 14.360 1.00 0.00 C ATOM 305 O PRO A 19 15.035 22.309 15.146 1.00 0.00 O ATOM 306 CB PRO A 19 12.915 24.630 15.185 1.00 0.00 C ATOM 307 CG PRO A 19 12.671 26.129 15.381 1.00 0.00 C ATOM 308 CD PRO A 19 13.748 26.830 14.557 1.00 0.00 C ATOM 0 HA PRO A 19 15.064 24.507 15.872 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.377 24.239 14.321 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.595 24.048 16.050 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.674 26.411 15.044 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.742 26.404 16.433 1.00 0.00 H new ATOM 0 HD2 PRO A 19 13.374 27.107 13.571 1.00 0.00 H new ATOM 0 HD3 PRO A 19 14.082 27.748 15.041 1.00 0.00 H new ATOM 316 N SER A 20 14.993 23.161 13.047 1.00 0.00 N ATOM 317 CA SER A 20 15.435 21.995 12.305 1.00 0.00 C ATOM 318 C SER A 20 16.899 22.069 11.857 1.00 0.00 C ATOM 319 O SER A 20 17.380 21.253 11.084 1.00 0.00 O ATOM 320 CB SER A 20 14.566 22.018 11.047 1.00 0.00 C ATOM 321 OG SER A 20 14.462 23.231 10.344 1.00 0.00 O ATOM 0 H SER A 20 14.817 23.962 12.441 1.00 0.00 H new ATOM 0 HA SER A 20 15.350 21.103 12.926 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.951 21.265 10.360 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.560 21.707 11.329 1.00 0.00 H new ATOM 0 HG SER A 20 13.882 23.108 9.564 1.00 0.00 H new ATOM 327 N ASP A 21 17.697 22.989 12.400 1.00 0.00 N ATOM 328 CA ASP A 21 19.133 23.132 12.272 1.00 0.00 C ATOM 329 C ASP A 21 19.859 21.971 12.941 1.00 0.00 C ATOM 330 O ASP A 21 19.384 21.466 13.955 1.00 0.00 O ATOM 331 CB ASP A 21 19.849 24.391 12.779 1.00 0.00 C ATOM 332 CG ASP A 21 19.836 25.621 11.887 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.018 25.522 10.659 1.00 0.00 O ATOM 334 OD2 ASP A 21 19.797 26.736 12.463 1.00 0.00 O ATOM 0 H ASP A 21 17.308 23.719 12.997 1.00 0.00 H new ATOM 0 HA ASP A 21 19.194 23.183 11.185 1.00 0.00 H new ATOM 0 HB2 ASP A 21 19.405 24.666 13.736 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.889 24.129 12.974 1.00 0.00 H new ATOM 339 N THR A 22 20.917 21.494 12.298 1.00 0.00 N ATOM 340 CA THR A 22 21.928 20.568 12.793 1.00 0.00 C ATOM 341 C THR A 22 22.808 21.346 13.783 1.00 0.00 C ATOM 342 O THR A 22 23.048 22.521 13.502 1.00 0.00 O ATOM 343 CB THR A 22 22.619 19.996 11.561 1.00 0.00 C ATOM 344 OG1 THR A 22 23.395 21.028 10.982 1.00 0.00 O ATOM 345 CG2 THR A 22 21.757 19.296 10.499 1.00 0.00 C ATOM 0 H THR A 22 21.106 21.769 11.334 1.00 0.00 H new ATOM 0 HA THR A 22 21.556 19.712 13.356 1.00 0.00 H new ATOM 0 HB THR A 22 23.216 19.164 11.935 1.00 0.00 H new ATOM 0 HG1 THR A 22 24.281 20.680 10.749 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.394 18.945 9.687 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.242 18.447 10.950 1.00 0.00 H new ATOM 0 HG23 THR A 22 21.022 19.999 10.106 1.00 0.00 H new ATOM 353 N ILE A 23 23.484 20.771 14.764 1.00 0.00 N ATOM 354 CA ILE A 23 24.418 21.340 15.719 1.00 0.00 C ATOM 355 C ILE A 23 25.657 21.703 14.905 1.00 0.00 C ATOM 356 O ILE A 23 26.245 22.751 15.172 1.00 0.00 O ATOM 357 CB ILE A 23 24.623 20.342 16.850 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.826 20.616 18.134 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.047 20.133 17.361 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.315 20.527 17.932 1.00 0.00 C ATOM 0 H ILE A 23 23.376 19.770 14.928 1.00 0.00 H new ATOM 0 HA ILE A 23 24.079 22.246 16.221 1.00 0.00 H new ATOM 0 HB ILE A 23 24.271 19.463 16.311 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.127 19.902 18.900 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.079 21.609 18.507 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.041 19.396 18.164 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.677 19.776 16.546 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.441 21.077 17.737 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.809 20.731 18.876 1.00 0.00 H new ATOM 0 HD12 ILE A 23 22.004 21.260 17.188 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.052 19.527 17.588 1.00 0.00 H new ATOM 372 N GLU A 24 26.043 21.062 13.811 1.00 0.00 N ATOM 373 CA GLU A 24 27.013 21.589 12.869 1.00 0.00 C ATOM 374 C GLU A 24 26.501 22.817 12.106 1.00 0.00 C ATOM 375 O GLU A 24 27.355 23.676 11.883 1.00 0.00 O ATOM 376 CB GLU A 24 27.306 20.537 11.804 1.00 0.00 C ATOM 377 CG GLU A 24 27.954 19.214 12.223 1.00 0.00 C ATOM 378 CD GLU A 24 28.416 18.231 11.153 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.618 18.015 10.226 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.560 17.728 11.080 1.00 0.00 O ATOM 0 H GLU A 24 25.682 20.144 13.551 1.00 0.00 H new ATOM 0 HA GLU A 24 27.888 21.861 13.459 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.364 20.299 11.309 1.00 0.00 H new ATOM 0 HB3 GLU A 24 27.952 20.997 11.056 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.820 19.455 12.840 1.00 0.00 H new ATOM 0 HG3 GLU A 24 27.243 18.690 12.862 1.00 0.00 H new ATOM 387 N ASN A 25 25.273 23.059 11.670 1.00 0.00 N ATOM 388 CA ASN A 25 24.772 24.345 11.247 1.00 0.00 C ATOM 389 C ASN A 25 24.650 25.355 12.400 1.00 0.00 C ATOM 390 O ASN A 25 24.779 26.542 12.129 1.00 0.00 O ATOM 391 CB ASN A 25 23.415 24.162 10.575 1.00 0.00 C ATOM 392 CG ASN A 25 23.215 25.205 9.480 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.958 25.260 8.498 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.182 26.041 9.524 1.00 0.00 N ATOM 0 H ASN A 25 24.570 22.323 11.601 1.00 0.00 H new ATOM 0 HA ASN A 25 25.497 24.758 10.545 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.346 23.161 10.149 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.621 24.248 11.317 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.026 26.699 8.761 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.546 26.024 10.321 1.00 0.00 H new ATOM 401 N VAL A 26 24.620 24.912 13.659 1.00 0.00 N ATOM 402 CA VAL A 26 24.661 25.870 14.738 1.00 0.00 C ATOM 403 C VAL A 26 26.052 26.447 15.028 1.00 0.00 C ATOM 404 O VAL A 26 26.309 27.621 15.282 1.00 0.00 O ATOM 405 CB VAL A 26 24.029 25.262 15.999 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.075 26.297 17.124 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.590 24.859 15.704 1.00 0.00 C ATOM 0 H VAL A 26 24.569 23.932 13.939 1.00 0.00 H new ATOM 0 HA VAL A 26 24.075 26.728 14.408 1.00 0.00 H new ATOM 0 HB VAL A 26 24.582 24.374 16.306 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.629 25.876 18.025 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.111 26.569 17.326 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.518 27.185 16.824 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.142 24.428 16.599 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.021 25.738 15.401 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.576 24.123 14.900 1.00 0.00 H new ATOM 417 N LYS A 27 27.102 25.642 14.868 1.00 0.00 N ATOM 418 CA LYS A 27 28.512 25.968 14.959 1.00 0.00 C ATOM 419 C LYS A 27 28.859 26.837 13.740 1.00 0.00 C ATOM 420 O LYS A 27 29.600 27.786 13.974 1.00 0.00 O ATOM 421 CB LYS A 27 29.246 24.633 14.940 1.00 0.00 C ATOM 422 CG LYS A 27 29.178 23.699 16.156 1.00 0.00 C ATOM 423 CD LYS A 27 30.004 22.430 16.015 1.00 0.00 C ATOM 424 CE LYS A 27 30.442 21.724 17.303 1.00 0.00 C ATOM 425 NZ LYS A 27 31.278 20.551 17.007 1.00 0.00 N ATOM 0 H LYS A 27 26.967 24.655 14.651 1.00 0.00 H new ATOM 0 HA LYS A 27 28.786 26.522 15.857 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.877 24.073 14.081 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.299 24.845 14.754 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.517 24.243 17.037 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.138 23.424 16.331 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.430 21.719 15.420 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.900 22.673 15.444 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.997 22.420 17.932 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.563 21.414 17.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.698 20.193 17.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.693 19.808 16.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 32.035 20.822 16.348 1.00 0.00 H new ATOM 439 N ALA A 28 28.276 26.622 12.563 1.00 0.00 N ATOM 440 CA ALA A 28 28.361 27.515 11.424 1.00 0.00 C ATOM 441 C ALA A 28 27.813 28.934 11.647 1.00 0.00 C ATOM 442 O ALA A 28 28.475 29.871 11.225 1.00 0.00 O ATOM 443 CB ALA A 28 27.639 26.975 10.194 1.00 0.00 C ATOM 0 H ALA A 28 27.714 25.792 12.376 1.00 0.00 H new ATOM 0 HA ALA A 28 29.439 27.572 11.273 1.00 0.00 H new ATOM 0 HB1 ALA A 28 27.737 27.686 9.373 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.080 26.022 9.903 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.584 26.831 10.426 1.00 0.00 H new ATOM 449 N LYS A 29 26.774 29.067 12.476 1.00 0.00 N ATOM 450 CA LYS A 29 26.162 30.340 12.781 1.00 0.00 C ATOM 451 C LYS A 29 27.020 31.058 13.818 1.00 0.00 C ATOM 452 O LYS A 29 27.098 32.283 13.701 1.00 0.00 O ATOM 453 CB LYS A 29 24.702 30.107 13.156 1.00 0.00 C ATOM 454 CG LYS A 29 23.891 29.714 11.924 1.00 0.00 C ATOM 455 CD LYS A 29 22.378 29.627 12.135 1.00 0.00 C ATOM 456 CE LYS A 29 21.721 29.390 10.776 1.00 0.00 C ATOM 457 NZ LYS A 29 20.410 28.735 10.977 1.00 0.00 N ATOM 0 H LYS A 29 26.338 28.278 12.954 1.00 0.00 H new ATOM 0 HA LYS A 29 26.128 31.014 11.925 1.00 0.00 H new ATOM 0 HB2 LYS A 29 24.634 29.322 13.909 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.285 31.011 13.600 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.090 30.437 11.133 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.247 28.747 11.568 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.136 28.816 12.821 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.003 30.547 12.584 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.591 30.337 10.251 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.361 28.765 10.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.170 28.173 10.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.457 28.111 11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.680 29.460 11.130 1.00 0.00 H new ATOM 471 N ILE A 30 27.750 30.323 14.650 1.00 0.00 N ATOM 472 CA ILE A 30 28.719 30.922 15.544 1.00 0.00 C ATOM 473 C ILE A 30 29.982 31.281 14.752 1.00 0.00 C ATOM 474 O ILE A 30 30.521 32.374 14.938 1.00 0.00 O ATOM 475 CB ILE A 30 29.028 29.988 16.715 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.857 29.754 17.674 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.263 30.380 17.534 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.028 28.696 18.766 1.00 0.00 C ATOM 0 H ILE A 30 27.684 29.308 14.720 1.00 0.00 H new ATOM 0 HA ILE A 30 28.306 31.836 15.970 1.00 0.00 H new ATOM 0 HB ILE A 30 29.239 29.052 16.197 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.628 30.702 18.160 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.986 29.482 17.078 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.406 29.663 18.342 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.142 30.380 16.889 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.120 31.376 17.953 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.120 28.642 19.366 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.217 27.726 18.306 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.869 28.965 19.405 1.00 0.00 H new ATOM 490 N GLN A 31 30.456 30.497 13.797 1.00 0.00 N ATOM 491 CA GLN A 31 31.589 30.744 12.930 1.00 0.00 C ATOM 492 C GLN A 31 31.387 32.019 12.098 1.00 0.00 C ATOM 493 O GLN A 31 32.325 32.752 11.808 1.00 0.00 O ATOM 494 CB GLN A 31 31.706 29.605 11.912 1.00 0.00 C ATOM 495 CG GLN A 31 33.064 29.602 11.209 1.00 0.00 C ATOM 496 CD GLN A 31 33.227 28.491 10.180 1.00 0.00 C ATOM 497 OE1 GLN A 31 32.224 27.898 9.785 1.00 0.00 O ATOM 498 NE2 GLN A 31 34.391 28.351 9.561 1.00 0.00 N ATOM 0 H GLN A 31 30.019 29.598 13.595 1.00 0.00 H new ATOM 0 HA GLN A 31 32.469 30.832 13.568 1.00 0.00 H new ATOM 0 HB2 GLN A 31 31.557 28.651 12.417 1.00 0.00 H new ATOM 0 HB3 GLN A 31 30.914 29.700 11.170 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.209 30.563 10.716 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.849 29.507 11.959 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.213 28.850 9.901 1.00 0.00 H new ATOM 0 HE22 GLN A 31 34.465 27.744 8.744 1.00 0.00 H new ATOM 507 N ASP A 32 30.123 32.309 11.801 1.00 0.00 N ATOM 508 CA ASP A 32 29.633 33.500 11.127 1.00 0.00 C ATOM 509 C ASP A 32 30.171 34.723 11.870 1.00 0.00 C ATOM 510 O ASP A 32 30.652 35.645 11.222 1.00 0.00 O ATOM 511 CB ASP A 32 28.125 33.552 10.901 1.00 0.00 C ATOM 512 CG ASP A 32 27.602 34.684 10.022 1.00 0.00 C ATOM 513 OD1 ASP A 32 27.866 34.611 8.801 1.00 0.00 O ATOM 514 OD2 ASP A 32 26.880 35.598 10.480 1.00 0.00 O ATOM 0 H ASP A 32 29.365 31.671 12.043 1.00 0.00 H new ATOM 0 HA ASP A 32 30.014 33.481 10.106 1.00 0.00 H new ATOM 0 HB2 ASP A 32 27.815 32.606 10.458 1.00 0.00 H new ATOM 0 HB3 ASP A 32 27.638 33.623 11.873 1.00 0.00 H new ATOM 519 N LYS A 33 30.265 34.696 13.196 1.00 0.00 N ATOM 520 CA LYS A 33 30.545 35.836 14.057 1.00 0.00 C ATOM 521 C LYS A 33 31.887 35.578 14.729 1.00 0.00 C ATOM 522 O LYS A 33 32.628 36.529 14.985 1.00 0.00 O ATOM 523 CB LYS A 33 29.433 36.058 15.081 1.00 0.00 C ATOM 524 CG LYS A 33 28.080 36.488 14.512 1.00 0.00 C ATOM 525 CD LYS A 33 27.083 35.412 14.073 1.00 0.00 C ATOM 526 CE LYS A 33 25.702 35.966 13.756 1.00 0.00 C ATOM 527 NZ LYS A 33 25.520 36.633 12.452 1.00 0.00 N ATOM 0 H LYS A 33 30.141 33.832 13.725 1.00 0.00 H new ATOM 0 HA LYS A 33 30.589 36.752 13.467 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.293 35.135 15.643 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.765 36.816 15.791 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.588 37.105 15.264 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.274 37.128 13.651 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.473 34.902 13.192 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.995 34.664 14.861 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.988 35.145 13.817 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.437 36.678 14.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.652 36.280 12.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.443 37.660 12.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 26.336 36.429 11.841 1.00 0.00 H new ATOM 541 N GLU A 34 32.190 34.390 15.252 1.00 0.00 N ATOM 542 CA GLU A 34 33.417 34.305 16.008 1.00 0.00 C ATOM 543 C GLU A 34 34.597 33.825 15.146 1.00 0.00 C ATOM 544 O GLU A 34 35.754 34.150 15.355 1.00 0.00 O ATOM 545 CB GLU A 34 33.266 33.297 17.150 1.00 0.00 C ATOM 546 CG GLU A 34 32.206 33.663 18.187 1.00 0.00 C ATOM 547 CD GLU A 34 32.578 34.751 19.185 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.753 35.151 19.301 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.690 35.341 19.846 1.00 0.00 O ATOM 0 H GLU A 34 31.641 33.534 15.171 1.00 0.00 H new ATOM 0 HA GLU A 34 33.617 35.310 16.380 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.020 32.323 16.727 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.227 33.192 17.654 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.306 33.978 17.658 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.949 32.762 18.744 1.00 0.00 H new ATOM 556 N GLY A 35 34.299 33.118 14.056 1.00 0.00 N ATOM 557 CA GLY A 35 35.284 32.666 13.094 1.00 0.00 C ATOM 558 C GLY A 35 36.022 31.399 13.513 1.00 0.00 C ATOM 559 O GLY A 35 37.159 31.213 13.083 1.00 0.00 O ATOM 0 H GLY A 35 33.346 32.842 13.819 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.789 32.488 12.139 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.011 33.462 12.932 1.00 0.00 H new ATOM 563 N ILE A 36 35.403 30.540 14.315 1.00 0.00 N ATOM 564 CA ILE A 36 35.975 29.320 14.862 1.00 0.00 C ATOM 565 C ILE A 36 35.375 28.144 14.087 1.00 0.00 C ATOM 566 O ILE A 36 34.148 28.152 14.049 1.00 0.00 O ATOM 567 CB ILE A 36 35.641 29.257 16.353 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.110 30.412 17.241 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.353 28.044 16.937 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.275 30.505 18.521 1.00 0.00 C ATOM 0 H ILE A 36 34.439 30.685 14.615 1.00 0.00 H new ATOM 0 HA ILE A 36 37.060 29.288 14.762 1.00 0.00 H new ATOM 0 HB ILE A 36 34.551 29.258 16.365 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.160 30.272 17.499 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.039 31.349 16.689 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.134 27.971 18.002 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.007 27.142 16.433 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.428 28.150 16.794 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.633 31.335 19.130 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.229 30.670 18.262 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.367 29.576 19.084 1.00 0.00 H new ATOM 582 N PRO A 37 36.066 27.216 13.445 1.00 0.00 N ATOM 583 CA PRO A 37 35.501 26.101 12.709 1.00 0.00 C ATOM 584 C PRO A 37 34.691 25.089 13.528 1.00 0.00 C ATOM 585 O PRO A 37 35.205 24.803 14.612 1.00 0.00 O ATOM 586 CB PRO A 37 36.674 25.508 11.935 1.00 0.00 C ATOM 587 CG PRO A 37 37.876 25.831 12.828 1.00 0.00 C ATOM 588 CD PRO A 37 37.516 27.131 13.552 1.00 0.00 C ATOM 0 HA PRO A 37 34.713 26.451 12.042 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.558 24.434 11.787 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.773 25.957 10.947 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.063 25.026 13.539 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.783 25.951 12.236 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.837 27.108 14.593 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.000 27.991 13.089 1.00 0.00 H new ATOM 596 N PRO A 38 33.552 24.598 13.062 1.00 0.00 N ATOM 597 CA PRO A 38 32.838 23.608 13.840 1.00 0.00 C ATOM 598 C PRO A 38 33.648 22.455 14.450 1.00 0.00 C ATOM 599 O PRO A 38 33.271 21.940 15.502 1.00 0.00 O ATOM 600 CB PRO A 38 31.696 23.170 12.923 1.00 0.00 C ATOM 601 CG PRO A 38 31.568 24.135 11.742 1.00 0.00 C ATOM 602 CD PRO A 38 32.847 24.959 11.847 1.00 0.00 C ATOM 0 HA PRO A 38 32.493 24.054 14.773 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.880 22.159 12.558 1.00 0.00 H new ATOM 0 HB3 PRO A 38 30.761 23.142 13.482 1.00 0.00 H new ATOM 0 HG2 PRO A 38 31.503 23.606 10.791 1.00 0.00 H new ATOM 0 HG3 PRO A 38 30.677 24.758 11.822 1.00 0.00 H new ATOM 0 HD2 PRO A 38 33.481 24.780 10.978 1.00 0.00 H new ATOM 0 HD3 PRO A 38 32.608 26.023 11.854 1.00 0.00 H new ATOM 610 N ASP A 39 34.746 21.991 13.860 1.00 0.00 N ATOM 611 CA ASP A 39 35.598 20.937 14.366 1.00 0.00 C ATOM 612 C ASP A 39 35.988 21.038 15.840 1.00 0.00 C ATOM 613 O ASP A 39 35.903 20.084 16.599 1.00 0.00 O ATOM 614 CB ASP A 39 36.669 20.634 13.322 1.00 0.00 C ATOM 615 CG ASP A 39 37.792 19.689 13.740 1.00 0.00 C ATOM 616 OD1 ASP A 39 37.744 18.461 13.503 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.910 20.187 14.016 1.00 0.00 O ATOM 0 H ASP A 39 35.076 22.364 12.970 1.00 0.00 H new ATOM 0 HA ASP A 39 35.028 20.014 14.473 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.178 20.211 12.445 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.117 21.578 13.012 1.00 0.00 H new ATOM 622 N GLN A 40 36.333 22.262 16.238 1.00 0.00 N ATOM 623 CA GLN A 40 37.086 22.620 17.420 1.00 0.00 C ATOM 624 C GLN A 40 36.088 23.311 18.348 1.00 0.00 C ATOM 625 O GLN A 40 36.377 23.516 19.521 1.00 0.00 O ATOM 626 CB GLN A 40 38.174 23.671 17.189 1.00 0.00 C ATOM 627 CG GLN A 40 39.126 23.327 16.040 1.00 0.00 C ATOM 628 CD GLN A 40 40.090 24.464 15.767 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.433 25.315 16.586 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.627 24.572 14.557 1.00 0.00 N ATOM 0 H GLN A 40 36.069 23.085 15.696 1.00 0.00 H new ATOM 0 HA GLN A 40 37.559 21.709 17.788 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.702 24.631 16.983 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.752 23.790 18.105 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.685 22.424 16.286 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.550 23.111 15.140 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.385 23.899 13.830 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.281 25.328 14.355 1.00 0.00 H new ATOM 639 N GLN A 41 34.902 23.699 17.875 1.00 0.00 N ATOM 640 CA GLN A 41 33.782 23.985 18.749 1.00 0.00 C ATOM 641 C GLN A 41 33.264 22.748 19.474 1.00 0.00 C ATOM 642 O GLN A 41 33.091 21.704 18.856 1.00 0.00 O ATOM 643 CB GLN A 41 32.605 24.655 18.040 1.00 0.00 C ATOM 644 CG GLN A 41 32.977 25.972 17.341 1.00 0.00 C ATOM 645 CD GLN A 41 31.759 26.704 16.801 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.702 26.669 17.421 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.766 27.359 15.649 1.00 0.00 N ATOM 0 H GLN A 41 34.700 23.821 16.883 1.00 0.00 H new ATOM 0 HA GLN A 41 34.195 24.685 19.475 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.195 23.965 17.302 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.817 24.849 18.767 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.504 26.617 18.044 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.666 25.764 16.522 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.623 27.414 15.099 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.914 27.808 15.312 1.00 0.00 H new ATOM 656 N ARG A 42 32.921 22.886 20.755 1.00 0.00 N ATOM 657 CA ARG A 42 32.013 22.019 21.477 1.00 0.00 C ATOM 658 C ARG A 42 30.809 22.761 22.065 1.00 0.00 C ATOM 659 O ARG A 42 30.913 23.907 22.500 1.00 0.00 O ATOM 660 CB ARG A 42 32.880 21.210 22.435 1.00 0.00 C ATOM 661 CG ARG A 42 33.842 20.189 21.820 1.00 0.00 C ATOM 662 CD ARG A 42 34.448 19.183 22.795 1.00 0.00 C ATOM 663 NE ARG A 42 35.264 18.137 22.185 1.00 0.00 N ATOM 664 CZ ARG A 42 35.637 17.051 22.887 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.341 16.944 24.185 1.00 0.00 N ATOM 666 NH2 ARG A 42 36.298 16.042 22.298 1.00 0.00 N ATOM 0 H ARG A 42 33.289 23.640 21.335 1.00 0.00 H new ATOM 0 HA ARG A 42 31.493 21.318 20.825 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.466 21.909 23.032 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.220 20.680 23.122 1.00 0.00 H new ATOM 0 HG2 ARG A 42 33.312 19.640 21.042 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.653 20.729 21.332 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.060 19.724 23.516 1.00 0.00 H new ATOM 0 HD3 ARG A 42 33.640 18.711 23.354 1.00 0.00 H new ATOM 0 HE ARG A 42 35.556 18.231 21.212 1.00 0.00 H new ATOM 0 HH11 ARG A 42 34.827 17.690 24.654 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.629 16.116 24.707 1.00 0.00 H new ATOM 0 HH21 ARG A 42 36.524 16.092 21.305 1.00 0.00 H new ATOM 0 HH22 ARG A 42 36.574 15.226 22.844 1.00 0.00 H new ATOM 680 N LEU A 43 29.634 22.159 22.243 1.00 0.00 N ATOM 681 CA LEU A 43 28.416 22.738 22.771 1.00 0.00 C ATOM 682 C LEU A 43 27.835 21.934 23.927 1.00 0.00 C ATOM 683 O LEU A 43 27.963 20.714 23.857 1.00 0.00 O ATOM 684 CB LEU A 43 27.370 23.215 21.751 1.00 0.00 C ATOM 685 CG LEU A 43 27.759 24.162 20.619 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.923 24.015 19.347 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.945 25.647 20.943 1.00 0.00 C ATOM 0 H LEU A 43 29.507 21.176 22.000 1.00 0.00 H new ATOM 0 HA LEU A 43 28.756 23.687 23.185 1.00 0.00 H new ATOM 0 HB2 LEU A 43 26.942 22.324 21.291 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.571 23.699 22.313 1.00 0.00 H new ATOM 0 HG LEU A 43 28.766 23.787 20.439 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.271 24.727 18.599 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.026 23.002 18.959 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.875 24.211 19.575 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.219 26.186 20.036 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.014 26.053 21.338 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.735 25.761 21.686 1.00 0.00 H new ATOM 699 N ILE A 44 27.367 22.635 24.955 1.00 0.00 N ATOM 700 CA ILE A 44 27.188 22.167 26.319 1.00 0.00 C ATOM 701 C ILE A 44 25.882 22.681 26.938 1.00 0.00 C ATOM 702 O ILE A 44 25.656 23.884 26.913 1.00 0.00 O ATOM 703 CB ILE A 44 28.421 22.232 27.222 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.569 21.346 26.720 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.167 22.019 28.711 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.920 21.481 27.424 1.00 0.00 C ATOM 0 H ILE A 44 27.085 23.609 24.847 1.00 0.00 H new ATOM 0 HA ILE A 44 27.068 21.087 26.234 1.00 0.00 H new ATOM 0 HB ILE A 44 28.729 23.274 27.141 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.251 20.306 26.797 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.718 21.556 25.661 1.00 0.00 H new ATOM 0 HG21 ILE A 44 29.110 22.086 29.254 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.482 22.784 29.076 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.727 21.034 28.868 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.637 20.798 26.969 1.00 0.00 H new ATOM 0 HD12 ILE A 44 31.281 22.505 27.326 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.806 21.236 28.480 1.00 0.00 H new ATOM 718 N PHE A 45 25.079 21.774 27.490 1.00 0.00 N ATOM 719 CA PHE A 45 24.185 22.182 28.565 1.00 0.00 C ATOM 720 C PHE A 45 23.952 20.986 29.501 1.00 0.00 C ATOM 721 O PHE A 45 23.937 19.843 29.044 1.00 0.00 O ATOM 722 CB PHE A 45 22.843 22.819 28.200 1.00 0.00 C ATOM 723 CG PHE A 45 21.740 21.911 27.692 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.884 21.499 26.360 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.718 21.390 28.485 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.975 20.597 25.782 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.809 20.480 27.930 1.00 0.00 C ATOM 728 CZ PHE A 45 19.913 20.150 26.576 1.00 0.00 C ATOM 0 H PHE A 45 25.029 20.791 27.223 1.00 0.00 H new ATOM 0 HA PHE A 45 24.718 23.007 29.037 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.469 23.338 29.082 1.00 0.00 H new ATOM 0 HB3 PHE A 45 23.029 23.577 27.439 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.705 21.880 25.770 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.628 21.686 29.520 1.00 0.00 H new ATOM 0 HE1 PHE A 45 21.092 20.261 24.762 1.00 0.00 H new ATOM 0 HE2 PHE A 45 19.036 20.038 28.542 1.00 0.00 H new ATOM 0 HZ PHE A 45 19.150 19.531 26.128 1.00 0.00 H new ATOM 738 N ALA A 46 23.763 21.233 30.790 1.00 0.00 N ATOM 739 CA ALA A 46 23.476 20.330 31.883 1.00 0.00 C ATOM 740 C ALA A 46 24.631 19.376 32.172 1.00 0.00 C ATOM 741 O ALA A 46 24.423 18.200 32.480 1.00 0.00 O ATOM 742 CB ALA A 46 22.045 19.804 31.763 1.00 0.00 C ATOM 0 H ALA A 46 23.815 22.193 31.130 1.00 0.00 H new ATOM 0 HA ALA A 46 23.447 20.844 32.844 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.837 19.125 32.590 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.346 20.640 31.795 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.931 19.272 30.819 1.00 0.00 H new ATOM 748 N GLY A 47 25.824 19.761 31.737 1.00 0.00 N ATOM 749 CA GLY A 47 27.029 18.955 31.790 1.00 0.00 C ATOM 750 C GLY A 47 27.221 18.062 30.559 1.00 0.00 C ATOM 751 O GLY A 47 28.274 17.453 30.419 1.00 0.00 O ATOM 0 H GLY A 47 25.981 20.680 31.322 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.892 19.613 31.890 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.999 18.329 32.682 1.00 0.00 H new ATOM 755 N LYS A 48 26.287 18.025 29.616 1.00 0.00 N ATOM 756 CA LYS A 48 26.461 17.110 28.499 1.00 0.00 C ATOM 757 C LYS A 48 26.990 17.924 27.328 1.00 0.00 C ATOM 758 O LYS A 48 26.785 19.139 27.281 1.00 0.00 O ATOM 759 CB LYS A 48 25.070 16.586 28.141 1.00 0.00 C ATOM 760 CG LYS A 48 24.488 15.760 29.286 1.00 0.00 C ATOM 761 CD LYS A 48 23.152 15.054 29.037 1.00 0.00 C ATOM 762 CE LYS A 48 22.767 14.140 30.193 1.00 0.00 C ATOM 763 NZ LYS A 48 23.711 13.005 30.165 1.00 0.00 N ATOM 0 H LYS A 48 25.438 18.591 29.600 1.00 0.00 H new ATOM 0 HA LYS A 48 27.141 16.291 28.734 1.00 0.00 H new ATOM 0 HB2 LYS A 48 24.408 17.423 27.918 1.00 0.00 H new ATOM 0 HB3 LYS A 48 25.128 15.976 27.240 1.00 0.00 H new ATOM 0 HG2 LYS A 48 25.222 15.004 29.563 1.00 0.00 H new ATOM 0 HG3 LYS A 48 24.367 16.417 30.147 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.370 15.799 28.888 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.216 14.470 28.119 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.827 14.671 31.143 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.739 13.792 30.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 23.272 12.177 30.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 23.949 12.775 29.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.578 13.262 30.679 1.00 0.00 H new ATOM 777 N GLN A 49 27.613 17.276 26.355 1.00 0.00 N ATOM 778 CA GLN A 49 28.225 17.848 25.175 1.00 0.00 C ATOM 779 C GLN A 49 27.334 17.290 24.062 1.00 0.00 C ATOM 780 O GLN A 49 27.105 16.088 23.968 1.00 0.00 O ATOM 781 CB GLN A 49 29.657 17.351 24.978 1.00 0.00 C ATOM 782 CG GLN A 49 30.533 17.946 23.875 1.00 0.00 C ATOM 783 CD GLN A 49 30.977 16.813 22.955 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.895 16.054 23.242 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.414 16.772 21.752 1.00 0.00 N ATOM 0 H GLN A 49 27.708 16.261 26.376 1.00 0.00 H new ATOM 0 HA GLN A 49 28.293 18.935 25.216 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.182 17.497 25.922 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.605 16.276 24.805 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.978 18.697 23.313 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.400 18.447 24.307 1.00 0.00 H new ATOM 0 HE21 GLN A 49 29.650 17.409 21.524 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.745 16.104 21.056 1.00 0.00 H new ATOM 794 N LEU A 50 26.929 18.107 23.091 1.00 0.00 N ATOM 795 CA LEU A 50 26.072 17.720 21.992 1.00 0.00 C ATOM 796 C LEU A 50 26.818 17.198 20.765 1.00 0.00 C ATOM 797 O LEU A 50 27.894 17.709 20.459 1.00 0.00 O ATOM 798 CB LEU A 50 25.366 19.012 21.566 1.00 0.00 C ATOM 799 CG LEU A 50 24.597 19.798 22.631 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.836 20.868 21.845 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.838 18.812 23.520 1.00 0.00 C ATOM 0 H LEU A 50 27.203 19.089 23.055 1.00 0.00 H new ATOM 0 HA LEU A 50 25.421 16.913 22.329 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.117 19.677 21.138 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.668 18.763 20.767 1.00 0.00 H new ATOM 0 HG LEU A 50 25.179 20.342 23.375 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.255 21.481 22.534 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.545 21.498 21.308 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.166 20.388 21.132 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.286 19.361 24.283 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.141 18.236 22.912 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.545 18.136 24.000 1.00 0.00 H new ATOM 813 N GLU A 51 26.180 16.443 19.873 1.00 0.00 N ATOM 814 CA GLU A 51 26.892 15.674 18.869 1.00 0.00 C ATOM 815 C GLU A 51 26.741 16.424 17.535 1.00 0.00 C ATOM 816 O GLU A 51 25.647 16.918 17.241 1.00 0.00 O ATOM 817 CB GLU A 51 26.231 14.295 18.874 1.00 0.00 C ATOM 818 CG GLU A 51 26.907 13.318 17.900 1.00 0.00 C ATOM 819 CD GLU A 51 28.381 13.042 18.180 1.00 0.00 C ATOM 820 OE1 GLU A 51 28.796 12.911 19.346 1.00 0.00 O ATOM 821 OE2 GLU A 51 29.165 13.095 17.209 1.00 0.00 O ATOM 0 H GLU A 51 25.165 16.351 19.830 1.00 0.00 H new ATOM 0 HA GLU A 51 27.960 15.553 19.049 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.267 13.882 19.882 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.179 14.398 18.609 1.00 0.00 H new ATOM 0 HG2 GLU A 51 26.365 12.372 17.924 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.813 13.714 16.889 1.00 0.00 H new ATOM 828 N ASP A 52 27.804 16.443 16.750 1.00 0.00 N ATOM 829 CA ASP A 52 27.753 16.879 15.359 1.00 0.00 C ATOM 830 C ASP A 52 27.061 15.913 14.399 1.00 0.00 C ATOM 831 O ASP A 52 27.345 14.729 14.229 1.00 0.00 O ATOM 832 CB ASP A 52 29.139 16.899 14.726 1.00 0.00 C ATOM 833 CG ASP A 52 30.192 17.711 15.469 1.00 0.00 C ATOM 834 OD1 ASP A 52 30.257 18.933 15.243 1.00 0.00 O ATOM 835 OD2 ASP A 52 31.004 17.135 16.226 1.00 0.00 O ATOM 0 H ASP A 52 28.733 16.156 17.058 1.00 0.00 H new ATOM 0 HA ASP A 52 27.240 17.836 15.453 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.493 15.872 14.639 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.050 17.293 13.714 1.00 0.00 H new ATOM 840 N GLY A 53 26.060 16.508 13.759 1.00 0.00 N ATOM 841 CA GLY A 53 25.124 15.959 12.802 1.00 0.00 C ATOM 842 C GLY A 53 23.688 15.879 13.333 1.00 0.00 C ATOM 843 O GLY A 53 22.748 15.910 12.554 1.00 0.00 O ATOM 0 H GLY A 53 25.870 17.497 13.921 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.137 16.571 11.900 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.453 14.961 12.514 1.00 0.00 H new ATOM 847 N ARG A 54 23.454 15.732 14.640 1.00 0.00 N ATOM 848 CA ARG A 54 22.166 15.824 15.298 1.00 0.00 C ATOM 849 C ARG A 54 21.612 17.250 15.306 1.00 0.00 C ATOM 850 O ARG A 54 22.350 18.142 14.911 1.00 0.00 O ATOM 851 CB ARG A 54 22.354 15.368 16.747 1.00 0.00 C ATOM 852 CG ARG A 54 22.504 13.870 17.007 1.00 0.00 C ATOM 853 CD ARG A 54 21.314 13.042 16.522 1.00 0.00 C ATOM 854 NE ARG A 54 21.525 12.615 15.134 1.00 0.00 N ATOM 855 CZ ARG A 54 20.551 12.625 14.227 1.00 0.00 C ATOM 856 NH1 ARG A 54 19.335 13.159 14.408 1.00 0.00 N ATOM 857 NH2 ARG A 54 20.810 12.290 12.952 1.00 0.00 N ATOM 0 H ARG A 54 24.208 15.534 15.297 1.00 0.00 H new ATOM 0 HA ARG A 54 21.456 15.200 14.754 1.00 0.00 H new ATOM 0 HB2 ARG A 54 23.238 15.867 17.144 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.501 15.725 17.324 1.00 0.00 H new ATOM 0 HG2 ARG A 54 23.409 13.513 16.515 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.637 13.707 18.076 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.184 12.170 17.163 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.399 13.630 16.594 1.00 0.00 H new ATOM 0 HE ARG A 54 22.453 12.299 14.854 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.099 13.601 15.296 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.645 13.123 13.657 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.756 12.027 12.676 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.061 12.299 12.260 1.00 0.00 H new ATOM 871 N THR A 55 20.338 17.413 15.655 1.00 0.00 N ATOM 872 CA THR A 55 19.554 18.608 15.405 1.00 0.00 C ATOM 873 C THR A 55 19.222 19.187 16.784 1.00 0.00 C ATOM 874 O THR A 55 19.347 18.444 17.758 1.00 0.00 O ATOM 875 CB THR A 55 18.406 18.339 14.448 1.00 0.00 C ATOM 876 OG1 THR A 55 17.345 17.530 14.901 1.00 0.00 O ATOM 877 CG2 THR A 55 18.894 17.674 13.160 1.00 0.00 C ATOM 0 H THR A 55 19.809 16.686 16.137 1.00 0.00 H new ATOM 0 HA THR A 55 20.091 19.381 14.856 1.00 0.00 H new ATOM 0 HB THR A 55 18.015 19.348 14.315 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.676 17.439 14.190 1.00 0.00 H new ATOM 0 HG21 THR A 55 18.046 17.496 12.499 1.00 0.00 H new ATOM 0 HG22 THR A 55 19.611 18.327 12.663 1.00 0.00 H new ATOM 0 HG23 THR A 55 19.373 16.724 13.400 1.00 0.00 H new ATOM 885 N LEU A 56 18.745 20.428 16.856 1.00 0.00 N ATOM 886 CA LEU A 56 18.081 21.007 18.011 1.00 0.00 C ATOM 887 C LEU A 56 16.899 20.136 18.461 1.00 0.00 C ATOM 888 O LEU A 56 16.800 19.857 19.649 1.00 0.00 O ATOM 889 CB LEU A 56 17.700 22.467 17.769 1.00 0.00 C ATOM 890 CG LEU A 56 18.888 23.387 17.490 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.665 24.325 16.306 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.558 23.991 18.726 1.00 0.00 C ATOM 0 H LEU A 56 18.816 21.081 16.076 1.00 0.00 H new ATOM 0 HA LEU A 56 18.787 21.020 18.841 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.011 22.516 16.926 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.163 22.840 18.641 1.00 0.00 H new ATOM 0 HG LEU A 56 19.679 22.724 17.140 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.548 24.949 16.165 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.488 23.738 15.405 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.800 24.959 16.502 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.388 24.626 18.416 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.832 24.587 19.279 1.00 0.00 H new ATOM 0 HD23 LEU A 56 19.933 23.191 19.364 1.00 0.00 H new ATOM 904 N SER A 57 16.040 19.639 17.576 1.00 0.00 N ATOM 905 CA SER A 57 14.833 18.915 17.920 1.00 0.00 C ATOM 906 C SER A 57 15.197 17.616 18.644 1.00 0.00 C ATOM 907 O SER A 57 14.363 17.113 19.397 1.00 0.00 O ATOM 908 CB SER A 57 14.143 18.764 16.565 1.00 0.00 C ATOM 909 OG SER A 57 12.874 18.146 16.551 1.00 0.00 O ATOM 0 H SER A 57 16.174 19.735 16.569 1.00 0.00 H new ATOM 0 HA SER A 57 14.161 19.401 18.627 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.040 19.756 16.126 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.803 18.194 15.912 1.00 0.00 H new ATOM 0 HG SER A 57 12.538 18.110 15.631 1.00 0.00 H new ATOM 915 N ASP A 58 16.361 17.018 18.414 1.00 0.00 N ATOM 916 CA ASP A 58 16.748 15.707 18.892 1.00 0.00 C ATOM 917 C ASP A 58 16.846 15.723 20.421 1.00 0.00 C ATOM 918 O ASP A 58 16.488 14.764 21.110 1.00 0.00 O ATOM 919 CB ASP A 58 18.052 15.281 18.237 1.00 0.00 C ATOM 920 CG ASP A 58 17.770 14.976 16.777 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.705 14.373 16.485 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.650 15.317 15.961 1.00 0.00 O ATOM 0 H ASP A 58 17.093 17.462 17.860 1.00 0.00 H new ATOM 0 HA ASP A 58 15.991 14.972 18.618 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.797 16.072 18.323 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.460 14.403 18.737 1.00 0.00 H new ATOM 927 N TYR A 59 17.354 16.868 20.870 1.00 0.00 N ATOM 928 CA TYR A 59 17.593 17.060 22.287 1.00 0.00 C ATOM 929 C TYR A 59 16.414 17.864 22.841 1.00 0.00 C ATOM 930 O TYR A 59 16.397 18.210 24.015 1.00 0.00 O ATOM 931 CB TYR A 59 18.869 17.854 22.593 1.00 0.00 C ATOM 932 CG TYR A 59 20.106 17.112 22.145 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.600 16.091 22.964 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.754 17.392 20.933 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.783 15.431 22.610 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.938 16.725 20.602 1.00 0.00 C ATOM 937 CZ TYR A 59 22.420 15.667 21.393 1.00 0.00 C ATOM 938 OH TYR A 59 23.587 15.023 21.109 1.00 0.00 O ATOM 0 H TYR A 59 17.603 17.662 20.280 1.00 0.00 H new ATOM 0 HA TYR A 59 17.705 16.074 22.738 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.824 18.822 22.094 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.929 18.049 23.664 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.072 15.813 23.864 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.339 18.123 20.255 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.214 14.719 23.299 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.491 17.027 19.725 1.00 0.00 H new ATOM 0 HH TYR A 59 23.661 14.891 20.141 1.00 0.00 H new ATOM 948 N ASN A 60 15.428 18.369 22.098 1.00 0.00 N ATOM 949 CA ASN A 60 14.149 18.877 22.529 1.00 0.00 C ATOM 950 C ASN A 60 14.162 20.223 23.262 1.00 0.00 C ATOM 951 O ASN A 60 13.325 20.583 24.086 1.00 0.00 O ATOM 952 CB ASN A 60 13.387 17.773 23.273 1.00 0.00 C ATOM 953 CG ASN A 60 11.875 17.827 23.168 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.223 18.037 24.191 1.00 0.00 O ATOM 955 ND2 ASN A 60 11.279 17.530 22.010 1.00 0.00 N ATOM 0 H ASN A 60 15.526 18.433 21.085 1.00 0.00 H new ATOM 0 HA ASN A 60 13.605 19.141 21.622 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.724 16.808 22.895 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.661 17.816 24.327 1.00 0.00 H new ATOM 0 HD21 ASN A 60 10.262 17.473 21.960 1.00 0.00 H new ATOM 0 HD22 ASN A 60 11.841 17.360 21.176 1.00 0.00 H new ATOM 962 N ILE A 61 15.213 20.990 23.006 1.00 0.00 N ATOM 963 CA ILE A 61 15.565 22.308 23.507 1.00 0.00 C ATOM 964 C ILE A 61 14.976 23.349 22.551 1.00 0.00 C ATOM 965 O ILE A 61 14.974 23.240 21.330 1.00 0.00 O ATOM 966 CB ILE A 61 17.093 22.321 23.551 1.00 0.00 C ATOM 967 CG1 ILE A 61 17.777 21.993 22.222 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.572 21.664 24.848 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.301 22.079 22.285 1.00 0.00 C ATOM 0 H ILE A 61 15.928 20.658 22.359 1.00 0.00 H new ATOM 0 HA ILE A 61 15.172 22.538 24.497 1.00 0.00 H new ATOM 0 HB ILE A 61 17.468 23.341 23.629 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.490 20.988 21.913 1.00 0.00 H new ATOM 0 HG13 ILE A 61 17.413 22.678 21.456 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.662 21.673 24.880 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.180 22.216 25.702 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.216 20.634 24.887 1.00 0.00 H new ATOM 0 HD11 ILE A 61 19.720 21.834 21.309 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.597 23.090 22.564 1.00 0.00 H new ATOM 0 HD13 ILE A 61 19.675 21.374 23.027 1.00 0.00 H new ATOM 981 N GLN A 62 14.305 24.291 23.191 1.00 0.00 N ATOM 982 CA GLN A 62 13.403 25.318 22.705 1.00 0.00 C ATOM 983 C GLN A 62 13.997 26.703 22.968 1.00 0.00 C ATOM 984 O GLN A 62 15.185 26.873 23.208 1.00 0.00 O ATOM 985 CB GLN A 62 12.091 25.192 23.467 1.00 0.00 C ATOM 986 CG GLN A 62 11.440 23.812 23.544 1.00 0.00 C ATOM 987 CD GLN A 62 11.062 23.168 22.221 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.143 23.850 21.207 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.601 21.920 22.269 1.00 0.00 N ATOM 0 H GLN A 62 14.395 24.360 24.205 1.00 0.00 H new ATOM 0 HA GLN A 62 13.245 25.196 21.633 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.261 25.539 24.486 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.373 25.876 23.013 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.121 23.142 24.068 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.540 23.892 24.154 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.568 21.422 23.159 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.281 21.461 21.416 1.00 0.00 H new ATOM 998 N LYS A 63 13.192 27.727 22.677 1.00 0.00 N ATOM 999 CA LYS A 63 13.519 29.114 22.424 1.00 0.00 C ATOM 1000 C LYS A 63 13.866 29.726 23.777 1.00 0.00 C ATOM 1001 O LYS A 63 13.081 29.680 24.725 1.00 0.00 O ATOM 1002 CB LYS A 63 12.222 29.697 21.858 1.00 0.00 C ATOM 1003 CG LYS A 63 12.048 31.208 21.955 1.00 0.00 C ATOM 1004 CD LYS A 63 10.639 31.739 21.658 1.00 0.00 C ATOM 1005 CE LYS A 63 10.573 33.236 21.933 1.00 0.00 C ATOM 1006 NZ LYS A 63 9.297 33.913 21.645 1.00 0.00 N ATOM 0 H LYS A 63 12.185 27.577 22.608 1.00 0.00 H new ATOM 0 HA LYS A 63 14.352 29.287 21.742 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.152 29.414 20.808 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.385 29.225 22.372 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.330 31.523 22.959 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.747 31.680 21.264 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.379 31.541 20.618 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.908 31.216 22.274 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.813 33.398 22.984 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.354 33.723 21.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.381 34.924 21.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.066 33.804 20.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.542 33.490 22.221 1.00 0.00 H new ATOM 1020 N GLU A 64 14.969 30.462 23.817 1.00 0.00 N ATOM 1021 CA GLU A 64 15.543 31.151 24.957 1.00 0.00 C ATOM 1022 C GLU A 64 16.259 30.215 25.931 1.00 0.00 C ATOM 1023 O GLU A 64 16.468 30.519 27.107 1.00 0.00 O ATOM 1024 CB GLU A 64 14.623 32.165 25.628 1.00 0.00 C ATOM 1025 CG GLU A 64 14.350 33.429 24.805 1.00 0.00 C ATOM 1026 CD GLU A 64 13.185 34.305 25.253 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.276 34.741 26.423 1.00 0.00 O ATOM 1028 OE2 GLU A 64 12.176 34.421 24.527 1.00 0.00 O ATOM 0 H GLU A 64 15.531 30.602 22.977 1.00 0.00 H new ATOM 0 HA GLU A 64 16.327 31.775 24.527 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.672 31.681 25.850 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.062 32.457 26.582 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.254 34.038 24.809 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.172 33.130 23.772 1.00 0.00 H new ATOM 1035 N SER A 65 16.716 29.121 25.353 1.00 0.00 N ATOM 1036 CA SER A 65 17.599 28.239 26.085 1.00 0.00 C ATOM 1037 C SER A 65 19.042 28.733 25.988 1.00 0.00 C ATOM 1038 O SER A 65 19.427 29.337 24.995 1.00 0.00 O ATOM 1039 CB SER A 65 17.444 26.826 25.528 1.00 0.00 C ATOM 1040 OG SER A 65 17.771 26.697 24.161 1.00 0.00 O ATOM 0 H SER A 65 16.496 28.827 24.401 1.00 0.00 H new ATOM 0 HA SER A 65 17.336 28.231 27.143 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.075 26.150 26.105 1.00 0.00 H new ATOM 0 HB3 SER A 65 16.413 26.502 25.674 1.00 0.00 H new ATOM 0 HG SER A 65 16.954 26.750 23.623 1.00 0.00 H new ATOM 1046 N THR A 66 19.854 28.564 27.018 1.00 0.00 N ATOM 1047 CA THR A 66 21.228 29.042 27.066 1.00 0.00 C ATOM 1048 C THR A 66 22.077 27.796 26.823 1.00 0.00 C ATOM 1049 O THR A 66 21.965 26.813 27.558 1.00 0.00 O ATOM 1050 CB THR A 66 21.473 29.512 28.504 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.483 30.476 28.814 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.849 30.149 28.706 1.00 0.00 C ATOM 0 H THR A 66 19.569 28.077 27.868 1.00 0.00 H new ATOM 0 HA THR A 66 21.445 29.840 26.355 1.00 0.00 H new ATOM 0 HB THR A 66 21.428 28.638 29.154 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.613 30.795 29.731 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.957 30.459 29.745 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.625 29.424 28.461 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.947 31.018 28.056 1.00 0.00 H new ATOM 1060 N LEU A 67 22.837 27.853 25.738 1.00 0.00 N ATOM 1061 CA LEU A 67 23.809 26.832 25.397 1.00 0.00 C ATOM 1062 C LEU A 67 25.156 27.408 25.844 1.00 0.00 C ATOM 1063 O LEU A 67 25.357 28.617 25.945 1.00 0.00 O ATOM 1064 CB LEU A 67 23.734 26.638 23.883 1.00 0.00 C ATOM 1065 CG LEU A 67 24.551 25.507 23.242 1.00 0.00 C ATOM 1066 CD1 LEU A 67 24.194 24.097 23.703 1.00 0.00 C ATOM 1067 CD2 LEU A 67 24.339 25.454 21.734 1.00 0.00 C ATOM 0 H LEU A 67 22.793 28.618 25.065 1.00 0.00 H new ATOM 0 HA LEU A 67 23.646 25.863 25.869 1.00 0.00 H new ATOM 0 HB2 LEU A 67 22.688 26.479 23.622 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.041 27.573 23.415 1.00 0.00 H new ATOM 0 HG LEU A 67 25.568 25.757 23.545 1.00 0.00 H new ATOM 0 HD11 LEU A 67 24.829 23.375 23.190 1.00 0.00 H new ATOM 0 HD12 LEU A 67 24.348 24.016 24.779 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.149 23.892 23.470 1.00 0.00 H new ATOM 0 HD21 LEU A 67 24.932 24.643 21.312 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.284 25.282 21.521 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.650 26.400 21.289 1.00 0.00 H new ATOM 1079 N HIS A 68 26.119 26.573 26.212 1.00 0.00 N ATOM 1080 CA HIS A 68 27.466 26.885 26.663 1.00 0.00 C ATOM 1081 C HIS A 68 28.484 26.390 25.630 1.00 0.00 C ATOM 1082 O HIS A 68 28.410 25.203 25.334 1.00 0.00 O ATOM 1083 CB HIS A 68 27.819 26.144 27.954 1.00 0.00 C ATOM 1084 CG HIS A 68 27.096 26.589 29.194 1.00 0.00 C ATOM 1085 ND1 HIS A 68 27.478 27.764 29.837 1.00 0.00 N ATOM 1086 CD2 HIS A 68 26.004 26.103 29.861 1.00 0.00 C ATOM 1087 CE1 HIS A 68 26.573 27.964 30.799 1.00 0.00 C ATOM 1088 NE2 HIS A 68 25.737 26.926 30.933 1.00 0.00 N ATOM 0 H HIS A 68 25.960 25.566 26.201 1.00 0.00 H new ATOM 0 HA HIS A 68 27.499 27.964 26.811 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.621 25.083 27.805 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.890 26.248 28.126 1.00 0.00 H new ATOM 0 HD2 HIS A 68 25.444 25.220 29.591 1.00 0.00 H new ATOM 0 HE1 HIS A 68 26.521 28.860 31.400 1.00 0.00 H new ATOM 0 HE2 HIS A 68 25.049 26.777 31.671 1.00 0.00 H new ATOM 1096 N LEU A 69 29.258 27.334 25.096 1.00 0.00 N ATOM 1097 CA LEU A 69 30.265 27.246 24.060 1.00 0.00 C ATOM 1098 C LEU A 69 31.589 26.936 24.747 1.00 0.00 C ATOM 1099 O LEU A 69 32.044 27.669 25.625 1.00 0.00 O ATOM 1100 CB LEU A 69 30.394 28.577 23.317 1.00 0.00 C ATOM 1101 CG LEU A 69 31.288 28.590 22.076 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.077 27.411 21.117 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.113 29.897 21.313 1.00 0.00 C ATOM 0 H LEU A 69 29.176 28.295 25.427 1.00 0.00 H new ATOM 0 HA LEU A 69 29.992 26.476 23.339 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.396 28.898 23.020 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.773 29.321 24.017 1.00 0.00 H new ATOM 0 HG LEU A 69 32.304 28.492 22.458 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.754 27.507 20.268 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.280 26.476 21.640 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.047 27.411 20.761 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.755 29.893 20.432 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.073 30.001 21.004 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.386 30.733 21.957 1.00 0.00 H new ATOM 1115 N VAL A 70 32.316 26.015 24.123 1.00 0.00 N ATOM 1116 CA VAL A 70 33.708 25.769 24.440 1.00 0.00 C ATOM 1117 C VAL A 70 34.628 26.344 23.348 1.00 0.00 C ATOM 1118 O VAL A 70 34.378 26.044 22.184 1.00 0.00 O ATOM 1119 CB VAL A 70 33.975 24.277 24.647 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.320 23.924 25.289 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.921 23.495 25.440 1.00 0.00 C ATOM 0 H VAL A 70 31.950 25.419 23.381 1.00 0.00 H new ATOM 0 HA VAL A 70 33.931 26.279 25.377 1.00 0.00 H new ATOM 0 HB VAL A 70 33.954 23.970 23.601 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.403 22.842 25.388 1.00 0.00 H new ATOM 0 HG12 VAL A 70 36.131 24.294 24.662 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.385 24.384 26.275 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.225 22.451 25.518 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.827 23.921 26.439 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.961 23.556 24.928 1.00 0.00 H new ATOM 1131 N LEU A 71 35.455 27.321 23.715 1.00 0.00 N ATOM 1132 CA LEU A 71 36.244 28.139 22.821 1.00 0.00 C ATOM 1133 C LEU A 71 37.552 27.388 22.555 1.00 0.00 C ATOM 1134 O LEU A 71 38.097 26.839 23.513 1.00 0.00 O ATOM 1135 CB LEU A 71 36.625 29.476 23.460 1.00 0.00 C ATOM 1136 CG LEU A 71 36.665 30.716 22.572 1.00 0.00 C ATOM 1137 CD1 LEU A 71 37.568 30.568 21.339 1.00 0.00 C ATOM 1138 CD2 LEU A 71 35.275 31.128 22.085 1.00 0.00 C ATOM 0 H LEU A 71 35.594 27.569 24.695 1.00 0.00 H new ATOM 0 HA LEU A 71 35.661 28.329 21.920 1.00 0.00 H new ATOM 0 HB2 LEU A 71 35.922 29.670 24.270 1.00 0.00 H new ATOM 0 HB3 LEU A 71 37.609 29.360 23.913 1.00 0.00 H new ATOM 0 HG LEU A 71 37.082 31.486 23.221 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.544 31.490 20.758 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.590 30.367 21.659 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.211 29.742 20.724 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.358 32.015 21.457 1.00 0.00 H new ATOM 0 HD22 LEU A 71 34.836 30.314 21.508 1.00 0.00 H new ATOM 0 HD23 LEU A 71 34.640 31.348 22.943 1.00 0.00 H new